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Patent code US9951035

Compile Data Set for Download or QSAR
Found 6 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Matrix metalloproteinase 9


(Homo sapiens (Human))
BDBM389618
PNG
(US9951035, ND-336 (5))
Show SMILES NCc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1
Show InChI InChI=1S/C16H17NO3S2/c17-9-12-1-3-13(4-2-12)20-14-5-7-16(8-6-14)22(18,19)11-15-10-21-15/h1-8,15H,9-11,17H2
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MMDB

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US Patent
150n/an/an/an/an/an/an/an/a



University of Notre Dame du Lac

US Patent


Assay Description
The term selective inhibitor as used in reference to MMPs refers to an inhibitor that inhibits the enzymatic activity of one MMP in the presence of o...


US Patent US9951035 (2018)

More data for this
Ligand-Target Pair
Matrix metalloproteinase 9


(Homo sapiens (Human))
BDBM50442356
PNG
(CHEMBL2442885 | US9951035, ND-380)
Show SMILES COC(=O)Nc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1
Show InChI InChI=1/C17H17NO5S2/c1-22-17(19)18-12-2-4-13(5-3-12)23-14-6-8-16(9-7-14)25(20,21)11-15-10-24-15/h2-9,15H,10-11H2,1H3,(H,18,19)
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US Patent
180n/an/an/an/an/an/an/an/a



University of Notre Dame du Lac

US Patent


Assay Description
The term selective inhibitor as used in reference to MMPs refers to an inhibitor that inhibits the enzymatic activity of one MMP in the presence of o...


US Patent US9951035 (2018)

More data for this
Ligand-Target Pair
Matrix metalloproteinase 9


(Homo sapiens (Human))
BDBM50354624
PNG
(CHEMBL1834422 | US9951035, ND-322 (2))
Show SMILES Nc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1
Show InChI InChI=1/C15H15NO3S2/c16-11-1-3-12(4-2-11)19-13-5-7-15(8-6-13)21(17,18)10-14-9-20-14/h1-8,14H,9-10,16H2
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870n/an/an/an/an/an/an/an/a



University of Notre Dame du Lac

US Patent


Assay Description
The term selective inhibitor as used in reference to MMPs refers to an inhibitor that inhibits the enzymatic activity of one MMP in the presence of o...


US Patent US9951035 (2018)

More data for this
Ligand-Target Pair
Matrix metalloproteinase-8 (MPP-8)


(Homo sapiens (Human))
BDBM50354624
PNG
(CHEMBL1834422 | US9951035, ND-322 (2))
Show SMILES Nc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1
Show InChI InChI=1/C15H15NO3S2/c16-11-1-3-12(4-2-11)19-13-5-7-15(8-6-13)21(17,18)10-14-9-20-14/h1-8,14H,9-10,16H2
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US Patent
2.60E+3n/an/an/an/an/an/an/an/a



University of Notre Dame du Lac

US Patent


Assay Description
The term selective inhibitor as used in reference to MMPs refers to an inhibitor that inhibits the enzymatic activity of one MMP in the presence of o...


US Patent US9951035 (2018)

More data for this
Ligand-Target Pair
Matrix metalloproteinase-8 (MPP-8)


(Homo sapiens (Human))
BDBM389618
PNG
(US9951035, ND-336 (5))
Show SMILES NCc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1
Show InChI InChI=1S/C16H17NO3S2/c17-9-12-1-3-13(4-2-12)20-14-5-7-16(8-6-14)22(18,19)11-15-10-21-15/h1-8,15H,9-11,17H2
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7.70E+3n/an/an/an/an/an/an/an/a



University of Notre Dame du Lac

US Patent


Assay Description
The term selective inhibitor as used in reference to MMPs refers to an inhibitor that inhibits the enzymatic activity of one MMP in the presence of o...


US Patent US9951035 (2018)

More data for this
Ligand-Target Pair
Matrix metalloproteinase-8 (MPP-8)


(Homo sapiens (Human))
BDBM50442356
PNG
(CHEMBL2442885 | US9951035, ND-380)
Show SMILES COC(=O)Nc1ccc(Oc2ccc(cc2)S(=O)(=O)CC2CS2)cc1
Show InChI InChI=1/C17H17NO5S2/c1-22-17(19)18-12-2-4-13(5-3-12)23-14-6-8-16(9-7-14)25(20,21)11-15-10-24-15/h2-9,15H,10-11H2,1H3,(H,18,19)
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US Patent
1.30E+4n/an/an/an/an/an/an/an/a



University of Notre Dame du Lac

US Patent


Assay Description
The term selective inhibitor as used in reference to MMPs refers to an inhibitor that inhibits the enzymatic activity of one MMP in the presence of o...


US Patent US9951035 (2018)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%